%chk=000027232.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027232

0 1
 O    2.998200       1.046200     -0.6610000    
 O    5.001500       1.637100       1.178500    
 N    7.150200      -2.560700      0.2250000    
 C   -1.861900       1.736600     -0.3556000    
 C   -3.242300       1.185800     -0.7198000    
 C  -0.7454000      0.8551000     -0.9172000    
 C   -4.358700       2.051800     -0.1283000    
 C   0.6318000       1.386300     -0.5257000    
 C   -5.761500       1.553900     -0.4940000    
 C    1.747900      0.4910000      -1.044800    
 C   -6.058300      0.1574000     -8.8000000E-03
 C   -6.625600     -3.7799999E-02   1.250600    
 C   -5.765300     -0.9396000     -0.8192000    
 C    4.023800      0.1649000     -0.4366000    
 C   -6.899700      -1.329700       1.699400    
 C   -6.039500      -2.231400     -0.3704000    
 C   -6.606700      -2.426500      0.8888000    
 C    5.026000      0.4640000      0.4864000    
 C    4.059800      -1.039500      -1.139600    
 C    6.064400     -0.4412000      0.7061000    
 C    5.098000      -1.944500     -0.9198000    
 C    6.100300      -1.645400      3.0000000E-03
 C    6.063000       1.866400       2.102900    
 H   -1.757400       2.756300     -0.7457000    
 H   -1.767800       1.796500      0.7356000    
 H   -3.308800      0.1625000     -0.3362000    
 H   -3.346300       1.139500      -1.810400    
 H  -0.8262000      0.8093000      -2.010000    
 H  -0.8637000     -0.1685000     -0.5412000    
 H   -4.249300       3.082400     -0.4873000    
 H   -4.254200       2.082100      0.9636000    
 H   0.7699000       2.403500     -0.9130000    
 H   0.7119000       1.467800      0.5657000    
 H   -5.896100       1.596800      -1.582800    
 H   -6.506500       2.245900     -8.0700003E-02
 H    1.704500      0.4294000      -2.138300    
 H    1.596000     -0.5086000     -0.6169000    
 H   -6.856400      0.8086000       1.892000    
 H   -5.327700     -0.8025000      -1.804400    
 H   -7.340800      -1.481900       2.680100    
 H   -5.812400      -3.085400      -1.001800    
 H   -6.820300      -3.432400       1.238300    
 H    3.317900      -1.299100      -1.889000    
 H    6.870700     -0.2635000       1.410300    
 H    5.119000      -2.876800      -1.478500    
 H    7.877500      -2.346000      0.8941000    
 H    7.175900      -3.434100     -0.2842000    
 H    6.059100       1.129600       2.913400    
 H    7.032900       1.926600       1.597500    
 H    5.883900       2.844100       2.562600    


%chk=000027232-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027232

0 1
O 2.949111 0.603251 0.251215
O 5.170056 1.555356 1.362614
N 7.861096 -2.118774 -0.537790
C -1.937903 1.535615 -0.113045
C -3.303620 1.105093 -0.693768
C -0.779926 0.602574 -0.533410
C -4.459965 2.037290 -0.270254
C 0.582615 1.033954 0.055183
C -5.847016 1.618091 -0.840276
C 1.714206 0.089613 -0.357751
C -6.348571 0.286518 -0.296660
C -6.864938 0.197592 1.023489
C -6.296990 -0.896977 -1.077173
C 4.128537 -0.126791 0.008103
C -7.313067 -1.034657 1.548823
C -6.743692 -2.133948 -0.556810
C -7.253369 -2.207659 0.759592
C 5.323882 0.383744 0.606247
C 4.214074 -1.302048 -0.766320
C 6.553664 -0.281741 0.419963
C 5.444763 -1.972518 -0.955294
C 6.629297 -1.470225 -0.364024
C 6.367751 2.111234 1.988655
H -1.708496 2.573012 -0.434779
H -2.002722 1.560375 0.994670
H -3.528740 0.068443 -0.372807
H -3.240428 1.083054 -1.802582
H -0.716146 0.577888 -1.641732
H -1.014364 -0.433676 -0.211025
H -4.237342 3.071169 -0.605257
H -4.517920 2.070191 0.836933
H 0.834424 2.058957 -0.278120
H 0.528157 1.061319 1.160397
H -5.778039 1.571302 -1.944831
H -6.578806 2.414356 -0.598969
H 1.822313 0.061198 -1.464033
H 1.517087 -0.943903 0.001731
H -6.921370 1.103718 1.640514
H -5.907249 -0.847091 -2.101680
H -7.712444 -1.080829 2.568689
H -6.696959 -3.036071 -1.177857
H -7.603149 -3.164098 1.164356
H 3.316340 -1.714467 -1.236020
H 7.466664 0.112003 0.878904
H 5.478190 -2.884317 -1.562709
H 8.707918 -1.756524 -0.112150
H 7.924821 -2.964541 -1.094898
H 6.815159 1.401321 2.712897
H 7.127481 2.394409 1.232787
H 6.020923 3.010515 2.518963


